methyl 3-bromo-2-methyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylate
Chemical Structure Depiction of
methyl 3-bromo-2-methyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylate
methyl 3-bromo-2-methyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylate
Compound characteristics
| Compound ID: | Y504-7823 |
| Compound Name: | methyl 3-bromo-2-methyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylate |
| Molecular Weight: | 391.18 |
| Molecular Formula: | C15 H11 Br N4 O4 |
| Smiles: | Cc1c(c2nc(cc(C(=O)OC)n2n1)c1cccc(c1)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.3031 |
| logD: | 3.3031 |
| logSw: | -3.6495 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.076 |
| InChI Key: | KNJLDEPHNGPSIJ-UHFFFAOYSA-N |